SCHEMBL7038121

SCHEMBL7038121

O=C(O)/C=C/C(=O)OC(C(=O)Cc1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 7/20 0.55
TSHR P16473 1/20 0.41
CNR1 P21554 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
CNR2 P34972 1/20 0.40
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
KLK7 P49862 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
AKR1B1 P15121 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9764589 0.81 HCAR2 (0.65) HCAR2ALDH1A1LMNACYP2D6
SCHEMBL9163949 0.79 CES1 (0.50) TSHRCNR1CRHBPCRHR2ALDH1A1
SCHEMBL7441943 0.78 NPSR1 (0.45) TSHRCNR1CRHBPCRHR2ALDH1A1
SCHEMBL2487162 0.77 HCAR2 (0.59) HCAR2ALDH1A1LMNACYP2D6CYP2C19
SCHEMBL7599647 0.77 KMT2A (0.51) TSHRCRHBPCRHR2ALDH1A1LMNA
SCHEMBL28803484 0.74 HCAR2 (0.69) HCAR2CRHBPCRHR2ALDH1A1CYP2D6
SCHEMBL27534212 0.74 HCAR2 (0.69) HCAR2CRHBPCRHR2ALDH1A1CYP2D6
SCHEMBL27722749 0.73 HCAR2 (0.67) HCAR2CRHBPCRHR2ALDH1A1CYP2D6
SCHEMBL11095898 0.72 CNR2 (0.44) TSHRCNR1CRHBPCRHR2ALDH1A1
SCHEMBL3482646 0.72 HCAR2 (0.61) HCAR2TSHRALDH1A1LMNACYP2D6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030118544-A1 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-06-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030118544-A1 Antifouling coating composition and novel resin COL1A1, GLRA1, COL2A1 HCAR2 3143/4885TSHR 3581/4885CNR1 1021/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.